3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol

C10H16N2O — CID 82408899

IUPAC3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
SMILESCC(C)(N)CC(O)c1ccccn1
InChIInChI=1S/C10H16N2O/c1-10(2,11)7-9(13)8-5-3-4-6-12-8/h3-6,9,13H,7,11H2,1-2H3
InChIKeyJNWCHUVBXOODPW-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.24
Rot. Bonds3

About 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol

3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol (PubChem CID 82408899) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol.

Molecular Properties

Compound Name3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
PubChem CID82408899
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
SMILESCC(C)(N)CC(O)c1ccccn1
InChIInChI=1S/C10H16N2O/c1-10(2,11)7-9(13)8-5-3-4-6-12-8/h3-6,9,13H,7,11H2,1-2H3
InChIKeyJNWCHUVBXOODPW-UHFFFAOYSA-N
XLogP1.24
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-pyridin-2-ylbutan-1-ol
CID 151032283
5-methyl-1-pyridin-2-ylhexan-1-ol
CID 83158842
2-chloro-1-pyridin-2-ylethanol
CID 22145518
CID 172780589
CID 172780589
(1S)-3,3-dimethyl-1-pyridin-2-ylbutan-1-amine
CID 99737676
1,2-dipyridin-2-ylethanol
CID 11458306
4-hydroxy-4-pyridin-2-ylbutanal
CID 54060730
1-pyridin-2-ylpent-3-yn-1-ol
CID 62309977
2-(2-bromophenoxy)-1-pyridin-2-ylethanol
CID 117241374
2-(1-chloro-2,2-dimethylpropyl)pyridine
CID 146396915
3-amino-3-methyl-1-quinolin-6-ylbutan-1-ol
CID 112753988
(2-hydroxy-2-pyridin-2-ylethyl)-oxidoazanium
CID 167327930

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol?
The IUPAC name of 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol (CID 82408899) is 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol.
What is the SMILES notation for 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol?
The canonical SMILES for 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol is CC(C)(N)CC(O)c1ccccn1.
What is the InChIKey of 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol?
The InChIKey is JNWCHUVBXOODPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-10(2,11)7-9(13)8-5-3-4-6-12-8/h3-6,9,13H,7,11H2,1-2H3.
What are the key properties of 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol?
3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol is sourced from PubChem (CID 82408899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).